Details
Stereochemistry | ACHIRAL |
Molecular Formula | C8H12O |
Molecular Weight | 124.1803 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 2 |
Charge | 0 |
Stereo Comments | Assumed racemic |
SHOW SMILES / InChI
SMILES
C\C=C/CC\C=C\C=O
InChI
InChIKey=CBXNRMOWVZUZQA-BRXUXDTNSA-N
InChI=1S/C8H12O/c1-2-3-4-5-6-7-8-9/h2-3,6-8H,4-5H2,1H3/b3-2-,7-6+
Molecular Formula | C8H12O |
Molecular Weight | 124.1803 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 2 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:32:01 GMT 2023
by
admin
on
Sat Dec 16 19:32:01 GMT 2023
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Record UNII |
XA97AW7T5Y
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Record Status |
Validated (UNII)
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Record Version |
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-
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XA97AW7T5Y
Created by
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76917-23-2
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admin on Sat Dec 16 19:32:01 GMT 2023 , Edited by admin on Sat Dec 16 19:32:01 GMT 2023
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20836195
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149231-57-2
Created by
admin on Sat Dec 16 19:32:01 GMT 2023 , Edited by admin on Sat Dec 16 19:32:01 GMT 2023
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NON-SPECIFIC STEREOCHEMISTRY |
Related Record | Type | Details | ||
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IMPURITY -> PARENT |
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